BRD-K46698069-001-12-5
TL;DR: BRD-K46698069-001-12-5 (CAS 896805-70-2) is a chemical compound with molecular formula C19H29N5 and molecular weight 327.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-3-(3-methylbutylamino)-1-pyrrolidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
Also Known As: BRD-K46698069-001-12-5, 7-methyl-3-(3-methylbutylamino)-1-(1-pyrrolidinyl)-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile, 7-methyl-3-(3-methylbutylamino)-1-pyrrolidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile, 3-(isopentylamino)-7-methyl-1-(pyrrolidin-1-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile, 7-methyl-3-[(3-methylbutyl)amino]-1-(pyrrolidin-1-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
| Molecular Formula | C19H29N5 |
|---|---|
| Molecular Weight | 327.24 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.2423 |
| Heavy Atoms | 24 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 896805-70-2 |
|---|---|
| SMILES | CC(C)CCNC1=C(C2=C(CN(CC2)C)C(=N1)N3CCCC3)C#N |
| InChIKey | RGMLPLCSNQEKLO-UHFFFAOYSA-N |
Product Overview
BRD-K46698069-001-12-5 (CAS 896805-70-2), with molecular formula C19H29N5 and molecular weight 327.24 g/mol. IUPAC: 7-methyl-3-(3-methylbutylamino)-1-pyrrolidin-1-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile.
Chemical Property Profile of BRD-K46698069-001-12-5
Property Insights of BRD-K46698069-001-12-5
The XLogP value of 3.9 indicates that BRD-K46698069-001-12-5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, BRD-K46698069-001-12-5 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BRD-K46698069-001-12-5 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BRD-K46698069-001-12-5?
The CAS number of BRD-K46698069-001-12-5 is 896805-70-2.
What is the molecular formula of BRD-K46698069-001-12-5?
The molecular formula of BRD-K46698069-001-12-5 is C19H29N5.
What is the molecular weight of BRD-K46698069-001-12-5?
The molecular weight of BRD-K46698069-001-12-5 is 327.24 g/mol.
Where can I buy BRD-K46698069-001-12-5?
You can request a quote for BRD-K46698069-001-12-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K46698069-001-12-5?
Yes, KEHONG BIO provides custom synthesis services for BRD-K46698069-001-12-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.